검색결과 : 4건
| No. | Article |
|---|---|
| 1 |
Comparison of Effective Exchange Integrals of H-H and H-He-H Chains vs. Single Molecules: A Theoretical Study Tada K, Kawakami T, Kitagawa Y, Okumura M, Yamaguchi K, Tanaka S Chemistry Letters, 49(2), 137, 2020 |
| 2 |
Singlet-Triplet Energy Gaps in Binuclear Copper Complexes and Organic Diradicals by Approximate Spin Projected Spin-unrestricted Coupled Cluster Method Saito T, Takano Y Chemistry Letters, 48(12), 1441, 2019 |
| 3 |
Estimation of spin contamination error in dissociative adsorption of Au-2 onto MgO(001) surface: First application of approximate spin projection (AP) method to plane wave basis Tada K, Koga H, Okumura M, Tanaka S Chemical Physics Letters, 701, 103, 2018 |
| 4 |
Theoretical study on magnetic interactions of Mn-pi conjugated system Takano Y, Soda T, Kitagawa Y, Onishi T, Yoshioka Y, Yamaguchi K Molecular Crystals and Liquid Crystals Science and Technology. Section A. Molecular Crystals and Liquid Crystals, 342, 291, 2000 |